Information card for entry 7702751

Structure parameters

• Chemical name: hexaaquatris(chloranilato)digadolinium(III) hydrate
• Formula: C18 H32 Cl6 Gd2 O28
• Calculated formula: C18 H12 Cl6 Gd2 O28
• Title of publication: Dihydroxybenzoquinone and chloranilic acid derivatives of rare earth metals
• Authors of publication: Abrahams, Brendan F.; Coleiro, Joseph; Ha, Karen; Hoskins, Bernard F.; Orchard, Simon D.; Robson, Richard
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 8
• Pages of publication: 1586
• a: 9.381 ± 0.001 Å
• b: 9.941 ± 0.001 Å
• c: 11.311 ± 0.001 Å
• α: 76.9 ± 0.01°
• β: 77.15 ± 0.01°
• γ: 74.79 ± 0.01°
• Cell volume: 976.37 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0297
• Residual factor for significantly intense reflections: 0.0235
• Weighted residual factors for all reflections: 0.0586
• Weighted residual factors for significantly intense reflections: 0.0559
• Goodness-of-fit parameter for all reflections: 1.082
• Goodness-of-fit parameter for significantly intense reflections: 1.095
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No